SCHEMBL91678

SCHEMBL91678

Cc1cc(C)c(C(F)(F)Oc2ccc(S(F)(F)(F)(F)F)c(F)c2)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.33
DHODH Q02127 1/20 0.30
GPR3 P46089 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL91746 0.94 FFAR4 (0.32) FFAR4
SCHEMBL91685 0.92
SCHEMBL91702 0.90
SCHEMBL91681 0.81
SCHEMBL91675 0.79 FFAR4 (0.38) FFAR4
SCHEMBL14075234 0.75
SCHEMBL12829124 0.74 GPR3 (0.33) FFAR4GPR3
SCHEMBL91762 0.74
SCHEMBL91779 0.73 ERN1 (0.39) FFAR4
SCHEMBL91711 0.72 HSD17B1 (0.36) FFAR4DHODH

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129002-B2 Compounds for use in liquid crystal media MERCK PATENT GMBH (DE) 2012-03-06 US disclosed